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ETHYL ALPHA-(DODECYLTHIO)-ALPHA-(3,3,4,4,5,5,6,6,7,7,8,8,8-TRIDECAFLUOROOCT-1-YLTHIO)ACETATE
SpectraBase Compound ID FFoqZU3UFZm
InChI InChI=1S/C24H35F13O2S2/c1-3-5-6-7-8-9-10-11-12-13-15-40-18(17(38)39-4-2)41-16-14-19(25,26)20(27,28)21(29,30)22(31,32)23(33,34)24(35,36)37/h18H,3-16H2,1-2H3
InChIKey KKGCPZJYIDQUIC-UHFFFAOYSA-N
Mol Weight 666.6 g/mol
Molecular Formula C24H35F13O2S2
Exact Mass 666.187089 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GoOdNM27J3J
Name ETHYL ALPHA-(DODECYLTHIO)-ALPHA-(3,3,4,4,5,5,6,6,7,7,8,8,8-TRIDECAFLUOROOCT-1-YLTHIO)ACETATE
Comments NAME DEFINED (S.T.)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C24H35F13O2S2
InChI InChI=1S/C24H35F13O2S2/c1-3-5-6-7-8-9-10-11-12-13-15-40-18(17(38)39-4-2)41-16-14-19(25,26)20(27,28)21(29,30)22(31,32)23(33,34)24(35,36)37/h18H,3-16H2,1-2H3
InChIKey KKGCPZJYIDQUIC-UHFFFAOYSA-N
Instrument Name Bruker WH-90
Literature Reference S.Y.DIENG, L.ROMAN, F.SZONYI, A.CAMBON (1991) J.Fluor.Chem.: v.51, N2, 155-164.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d